1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5,5-dimethyl-2-oxabicyclo[2.1.1]hexane-1-carboxylate
Structure Info
- Chemspace ID
- CSSB02517389629 (In-Stock Building Blocks)
- CAS
- 3049064-77-6
- IUPAC Name
- 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5,5-dimethyl-2-oxabicyclo[2.1.1]hexane-1-carboxylate
- Mol formula
- C16H15NO5
- Mol weight
- 301 Da
- Catalog Number(s)
- BBV-340373429, EN300-37279615, m276436____152135006____31134370
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.99
- Heavy atoms count
- 22
- Rotatable bond count
- 3
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.437
- Polar surface area (Å)
- 73
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
![Chemical structure of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5,5-dimethyl-2-oxabicyclo[2.1.1]hexane-1-carboxylate (C16H15NO5) - CSSB02517389629](/st/structure/200/4b389bca209ed5a99cf9597a6bef256e/CC1%2528C%2529C2CC1%2528OC2%2529C%2528%253DO%2529ON1C%2528%253DO%2529C2%253DCC%253DCC%253DC2C1%253DO.png "C16H15NO5")
- Zoom the structure
- CSSB02517389629
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 2,061.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 2,159.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 2,258.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 2,356.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 2,454.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 4,810.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 7,118.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 10,553.00 |
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Substructure Analogs
![Chemical structure of 4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 5,5-dimethyl-2-oxabicyclo[2.1.1]hexane-1-carboxylate - CSSB20271340551](/st/structure/200/6fdd6634e2cfae6b3394d78fea94228f/CC1%2528C%2529C2CC1%2528OC2%2529C%2528%253DO%2529ON1C%2528%253DO%2529C2%253DC%2528Cl%2529C%2528Cl%2529%253DC%2528Cl%2529C%2528Cl%2529%253DC2C1%253DO.png)
Similarity Analogs
![Chemical structure of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl tricyclo[3.3.1.0³,⁷]nonane-3-carboxylate - CSSB06258921814](/st/structure/200/43b97cfad32f6c13108e075c9ce99a15/O%253DC%2528ON1C%2528%253DO%2529c2ccccc2C1%253DO%2529C34CC5CC4CC%2528C3%2529C5.png)
![Chemical structure of 2,5-dioxopyrrolidin-1-yl 5,5-dimethyl-2-oxabicyclo[2.1.1]hexane-1-carboxylate - CSSB02529833759](/st/structure/200/f1884d5a8ca804fdc6f686d7a56e4c1c/CC1%2528C%2529C2CC1%2528OC2%2529C%2528%253DO%2529ON1C%2528%253DO%2529CCC1%253DO.png)
![Chemical structure of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (1R,3r,5S)-3-methylbicyclo[3.1.0]hexane-3-carboxylate - CSSB06722229301](/st/structure/200/19f3355a09f516b6b5906f4dc76b72c1/C%255BC%2540%255D1%2528C%255BC%2540%2540H%255D2C%255BC%2540%2540H%255D2C1%2529C%2528%253DO%2529ON3C%2528%253DO%2529c4ccccc4C3%253DO.png)
